4-[5-[(2-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]aniline

Systemtic Name: 4-[5-[(2-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]aniline Openeye Name: 4-[5-[(2-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]aniline CAS Name: 4-[5-[(2-bromophenyl)methylthio]-4-ethyl-1,2,4-triazol-3-yl]aniline IUPAC Name: 4-[5-[(2-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]aniline Traditional Name: [4-[5-[(2-bromobenzyl)thio]-4-ethyl-1,2,4-triazol-3-yl]phenyl]amine Formula: C17H17BrN4S MolecularWeight: 389.31268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=CC=CC=C2Br)C3=CC=C(C=C3)N

Isomeric SMILES

CCN1C(=NN=C1SCC2=CC=CC=C2Br)C3=CC=C(C=C3)N

InChI

InChI=1S/C17H17BrN4S/c1-2-22-16(12-7-9-14(19)10-8-12)20-21-17(22)23-11-13-5-3-4-6-15(13)18/h3-10H,2,11,19H2,1H3